Vitas-M small molecule compound
methyl N-[(E)-(4-hydroxy-2,6-dioxo-1-phenyl-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]tryptophanate
Catalog ID
STK591568
SMILES COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H20N4O5 MW 432.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O5/c1-32-22(30)19(11-14-12-24-18-10-6-5-9-16(14)18)25-13-17-20(28)26-23(31)27(21(17)29)15-7-3-2-4-8-15/h2-10,12-13,19,24-25H,11H2,1H3,(H,26,28,31)/b17-13+InChIKey
LUDWYMXAAHUFIT-GHRIWEEISA-NSynonyms
COC(=O)C(CC1=CNC2=CC=CC=C21)NC=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4
COC(=O)C(Cc1c(nH)c2c1cccc2)NC=C1C(=NC(=O)N(C1=O)c1ccccc1)O
InChI=1SC23H20N4O5c13222(30)19(11141224181065916(14)18)25131720(28)2623(31)27(21(17)29)157324815h2101213192425H11H21H3(H262831)b1713+
METHYL3(1HINDOL3YL)2(((E)(246TRIOXO1PHENYL13DIAZINAN5YLIDENE)METHYL)AMINO)PROPANOATE
methylN((E)(4hydroxy26dioxo1phenyl16dihydropyrimidin5(2H)ylidene)methyl)tryptophanate
MFCD07205583
ZINC000002399123
ZINC000002399125
ZINC000102608985
ZINC000102608987
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